N-[4-[[(3-fluoranyl-4-methoxy-phenyl)methyl-methyl-carbamoyl]amino]phenyl]-3-methyl-butanamide

Systemtic Name: N-[4-[[(3-fluoranyl-4-methoxy-phenyl)methyl-methyl-carbamoyl]amino]phenyl]-3-methyl-butanamide Openeye Name: N-[4-[[(3-fluoro-4-methoxy-phenyl)methyl-methyl-carbamoyl]amino]phenyl]-3-methyl-butanamide CAS Name: N-[4-[[[(3-fluoro-4-methoxyphenyl)methyl-methylamino]-oxomethyl]amino]phenyl]-3-methylbutanamide IUPAC Name: N-[4-[[(3-fluoro-4-methoxyphenyl)methyl-methylcarbamoyl]amino]phenyl]-3-methylbutanamide Traditional Name: N-[4-[[(3-fluoro-4-methoxy-benzyl)-methyl-carbamoyl]amino]phenyl]-3-methyl-butyramide Formula: C21H26FN3O3 MolecularWeight: 387.447843

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(=O)NC1=CC=C(C=C1)NC(=O)N(C)CC2=CC(=C(C=C2)OC)F

Isomeric SMILES

CC(C)CC(=O)NC1=CC=C(C=C1)NC(=O)N(C)CC2=CC(=C(C=C2)OC)F

InChI

InChI=1S/C21H26FN3O3/c1-14(2)11-20(26)23-16-6-8-17(9-7-16)24-21(27)25(3)13-15-5-10-19(28-4)18(22)12-15/h5-10,12,14H,11,13H2,1-4H3,(H,23,26)(H,24,27)